Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1515217
Preview
Coordinates | 1515217.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C150 H162 N12 O2 Zn2 |
---|---|
Calculated formula | C150 H162 N12 O2 Zn2 |
Title of publication | Engineering conjugation in para-phenylene-bridged porphyrin tapes |
Authors of publication | Pawlicki, Miłosz; Morisue, Mitsuhiko; Davis, Nicola K. S.; McLean, Daniel G.; Haley, Joy E.; Beuerman, Erich; Drobizhev, Mikhail; Rebane, Aleksander; Thompson, Amber L.; Pascu, Sofia I.; Accorsi, Gianluca; Armaroli, Nicola; Anderson, Harry L. |
Journal of publication | Chemical Science |
Year of publication | 2012 |
Journal volume | 3 |
Journal issue | 5 |
Pages of publication | 1541 |
a | 11.998 ± 0.002 Å |
b | 14.379 ± 0.003 Å |
c | 19.482 ± 0.004 Å |
α | 82.891 ± 0.006° |
β | 87.456 ± 0.005° |
γ | 76.474 ± 0.005° |
Cell volume | 3242.3 ± 1.1 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.085 |
Residual factor for significantly intense reflections | 0.0704 |
Weighted residual factors for all reflections | 0.1331 |
Weighted residual factors for significantly intense reflections | 0.1272 |
Weighted residual factors for all reflections included in the refinement | 0.1331 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.9973 |
Diffraction radiation wavelength | 0.6889 Å |
Diffraction radiation type | Synchrotron |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1515217.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.